N-(3-methoxyphenyl)-3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(3-methoxyphenyl)-3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 3-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methoxyphenyl)propanamide CAS Name: N-(3-methoxyphenyl)-3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(3-methoxyphenyl)-3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 3-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(3-methoxyphenyl)propionamide Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SCCC(=O)NC2=CC(=CC=C2)OC

Isomeric SMILES

CC1=NN=C(N1CC=C)SCCC(=O)NC2=CC(=CC=C2)OC

InChI

InChI=1S/C16H20N4O2S/c1-4-9-20-12(2)18-19-16(20)23-10-8-15(21)17-13-6-5-7-14(11-13)22-3/h4-7,11H,1,8-10H2,2-3H3,(H,17,21)